Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3620139

CCOc1ccc2c(ccn2S(=O)(=O)c2ccc3ccccc3c2)c1CN(C)C.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 15/20 0.42
APP P05067 1/20 0.39
TSHR P16473 2/20 0.39
BCHE P06276 2/20 0.38
EGFR P00533 1/20 0.38
ERBB2 P04626 1/20 0.38
ERBB4 Q15303 1/20 0.38
TNF P01375 1/20 0.36
KDM4E B2RXH2 1/20 0.36
HSD17B10 Q99714 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3621651 0.92 HTR6 (0.48) HTR6TSHRKDM4EHSD17B10
Trifluoroacetic Acid SCHEMBL3621025 0.90 HTR6 (0.46) HTR6APPBCHE
Trifluoroacetic Acid SCHEMBL3623471 0.85 HTR6 (0.47) HTR6BCHE
Trifluoroacetic Acid SCHEMBL3619138 0.83 HTR6 (0.40) HTR6TSHRBCHE
SCHEMBL3622623 0.82 HTR6 (0.52) HTR6BCHE
Trifluoroacetic Acid SCHEMBL3624021 0.81 HTR6 (0.34) HTR6APPTSHRBCHEEGFR
Trifluoroacetic Acid SCHEMBL3620673 0.81 SLC2A1 (0.41) HTR6TSHRBCHE
SCHEMBL13504543 0.81 HTR6 (0.42) HTR6TSHREGFRERBB2ERBB4
Trifluoroacetic Acid SCHEMBL3617556 0.80 CPT2 (0.42) HTR6TSHRHSD17B10
Trifluoroacetic Acid SCHEMBL3616670 0.80 TSHR (0.40) TSHR

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2046741-B1 INDOLES AS 5-HT6 MODULATORS PROXIMAGEN LTD (GB) 2012-10-31 EP disclosed
US-7812017-B2 4-substituted indole and indoline compounds BIOVITRUM AB (PUBL.) (SE) 2010-10-12 US disclosed
EP-2046741-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (publ) (SE) 2009-04-15 EP disclosed
US-20080032968-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2008-02-07 US disclosed
WO-2008003703-A1 INDOLES AS 5-HT6 MODULATORS BIOVITRUM AB (PUBL) (SE) 2008-01-10 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080032968-A1 New compounds HTR6, HTR1B, HTR1A HTR6 1/4885APP 1233/4885TSHR 244/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.